ChemSpider 2D Image | [3,3'-{8-[(4E,8E)-1-Hydroxy-5,9,13-trimethyl-4,8,12-tetradecatrien-1-yl]-3,7,12,17-tetramethyl-13-vinyl-2,18-porphyrindiyl-kappa~2~N~22~,N~24~}dipropanoato(2-)]iron | C49H58FeN4O5

[3,3'-{8-[(4E,8E)-1-Hydroxy-5,9,13-trimethyl-4,8,12-tetradecatrien-1-yl]-3,7,12,17-tetramethyl-13-vinyl-2,18-porphyrindiyl-κ2N22,N24}dipropanoato(2-)]iron

  • Molecular FormulaC49H58FeN4O5
  • Average mass838.854 Da
  • Monoisotopic mass838.375671 Da
  • ChemSpider ID30792072

  • Charge - Charge

    Double-bond stereo - Double-bond stereo

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

[3,3'-{8-[(4E,8E)-1-Hydroxy-5,9,13-trimethyl-4,8,12-tetradecatrien-1-yl]-3,7,12,17-tetramethyl-13-vinyl-2,18-porphyrindiyl-κ2N22,N24}dipropanoato(2-)]eisen [German] [ACD/IUPAC Name]
[3,3'-{8-[(4E,8E)-1-Hydroxy-5,9,13-trimethyl-4,8,12-tetradecatrien-1-yl]-3,7,12,17-tetramethyl-13-vinyl-2,18-porphyrindiyl-κ2N22,N24}dipropanoato(2-)]iron [ACD/IUPAC Name]
[3,3'-{8-[(4E,8E)-1-Hydroxy-5,9,13-triméthyl-4,8,12-tétradécatrién-1-yl]-3,7,12,17-tétraméthyl-13-vinyl-2,18-porphyrinediyl-κ2N22,N24}dipropanato(2-)]fer [French] [ACD/IUPAC Name]
Iron, [7-ethenyl-12-[(4E,8E)-1-hydroxy-5,9,13-trimethyl-4,8,12-tetradecatrien-1-yl]-3,8,13,17-tetramethyl-21H,23H-porphine-2,18-dipropanoato(2-)-κN21,κN23]- [ACD/Index Name]
137397-56-9 [RN]
3-[20-(2-carboxyethyl)-15-ethenyl-10-[(4E,8E)-1-hydroxy-5,9,13-trimethyltetradeca-4,8,12-trien-1-yl]-5,9,14,19-tetramethyl-21,23,24,25-tetraaza-22-ferrahexacyclo[9.9.3.13,6.113,16.08,23.018,21]pentacosa-1(20),2,4,6(25),7,9,11,13(24),14,16,18-u
C15672
heme o [Wiki]

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 18
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 128 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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